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3172-56-3,MFCD00041214
Catalog No.:AA003I9T
3172-56-3 | 3,3'-Bithiophene
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250mg
95%
in stock  
$79.00   $55.00
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1g
95%
in stock  
$157.00   $110.00
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5g
95%
in stock  
$540.00   $378.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003I9T
Chemical Name:
3,3'-Bithiophene
CAS Number:
3172-56-3
Molecular Formula:
C8H6S2
Molecular Weight:
166.2632
MDL Number:
MFCD00041214
IUPAC Name:
3-thiophen-3-ylthiophene
InChI:
InChI=1S/C8H6S2/c1-3-9-5-7(1)8-2-4-10-6-8/h1-6H
InChI Key:
IAAQEGBHNXAHBF-UHFFFAOYSA-N
SMILES:
c1scc(c1)c1cscc1
Properties
Computed Properties
 
Complexity:
99.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.991g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.256g/mol
Monoisotopic Mass:
165.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Synonyms
 
3,3'-Bithiophene 
3172-56-3 
IAAQEGBHNXAHBF-UHFFFAOYSA-N 
3,3 -bithiophene 
3,3'-dithiophene 
3,3;-Bithiophene 
[3,3]Bithiophenyl 
AC1L2RCJ 
AC1Q7FYY 
3-(3-thienyl)-thiophene 
KSC222I1J 
BIDD:GT0497 
3,3'-Bithienyl 
C8H6S2 
SCHEMBL2125063 
CTK1C2414 
KS-00000NCF 
DTXSID90185613 
ZINC334271 
ANW-27185 
CB-271 
MFCD00041214 
SBB088036 
[3,3']Bithiophenyl 
AKOS006229664 
AC-4488 
RP10375 
TRA0027763 
VT20184 
AJ-19651 
AK-72774 
AN-11903 
BC218017 
BR-72774 
3,3'-Dithienyl 
CJ-02890 
DS-15246 
SC-45335 
SY030353 
ZB010732 
3,3 inverted exclamation mark -Bithiophene 
AB0006126 
DB-006264 
DB-049030 
ST2417204 
3-(3-thienyl)thiophene 
TC-115930 
4CH-015387 
B3906 
FT-0601643 
X4147 
MFCD00041214 (95%) 
S-2835 
172B563 
AI-942/25034504 
I09-0308 
3-thiophen-3-ylthiophene 
J-511061 
3,3'Bithiophenyl 
3,3/'-Bithiophene 
C8-H6-S2 
CID76638 
AR-1E8606 
ZINC00334271 
ACN-031887 
Naphthol as-mx-phosphate disodium salt nonahydrate 
33008-68-3 
3,3-Bithiophene 
36889-52-8 
3-(thiophen-3-yl)thiophene 
3-3'-Bithiophene 
Literature

Title: Thermochemistry of bithiophenes and thienyl radicals. A calorimetric and computational study.

Journal: The journal of physical chemistry. A 20091015

Title: Steric and electronic tuning of chiral bis(oxazoline) ligands with 3,3'-bithiophene backbone.

Journal: The Journal of organic chemistry 20050916

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

Title: Synthesis and properties of an aggregating heterocyclic helicene.

Journal: Journal of the American Chemical Society 20011205

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